Commit Graph

23055 Commits

Author SHA1 Message Date
1ad82d7cdb add separator comment lines 2020-08-26 19:07:08 -04:00
78a1b92503 Add dump atom zstd tests 2020-08-26 16:35:35 -04:00
007a43a5b2 Add more atom/gz tests 2020-08-26 16:20:02 -04:00
32aa35009b Start tests for compressed dump styles 2020-08-26 16:04:19 -04:00
046fd3d14b Verify valid compression level ranges 2020-08-26 16:03:18 -04:00
d00807ee9a Merge pull request #2311 from stanmoore1/kk_update_3.2
Update Kokkos library in LAMMPS to v3.2
2020-08-26 15:35:25 -04:00
aeb3e20385 Merge pull request #2307 from Vsevak/zbl_reduce_declaration
Fix NaN in GPU-accelerated Tersoff styles with OpenCL backend
2020-08-26 13:56:49 -04:00
629ead6348 Merge pull request #2309 from lammps/doxygen-integration
Add doxygen and graphviz processing into the documentation build
2020-08-26 13:05:00 -04:00
50b8b1bf60 Fix Kokkos HIP compile error 2020-08-26 11:45:24 -05:00
94db627ba5 fix formatting issue 2020-08-26 12:09:43 -04:00
b4403de026 add false positive 2020-08-26 12:09:35 -04:00
d40b658644 cmake: update kokkos version/checksum 2020-08-26 10:05:14 -06:00
8137ada848 Merge branch 'collected-small-changes' into doxygen-integration 2020-08-26 11:51:45 -04:00
bdc952ac88 Merge branch 'master' into collected-small-changes 2020-08-26 11:51:05 -04:00
f89a0f9fe3 must not try to delete computes if they have not been created and their ids not yet set 2020-08-26 11:50:20 -04:00
c8af729701 Merge branch 'master' into collected-small-changes 2020-08-26 11:49:29 -04:00
4ad68c98a0 Merge pull request #2196 from jibril-b-coulibaly/mindlin_rescale
Implement force history in Mindlin granular pair styles
2020-08-26 11:42:06 -04:00
e2fd95d8ed Merge pull request #2240 from jrgissing/bond/react-reset_mol_ids
support molecule ID resets in fix bond/react
2020-08-26 10:56:21 -04:00
ed63edc9da lammps_has_error() and lammps_get_last_error_message() are always available but dummies without exceptions enabled 2020-08-26 09:10:59 -04:00
48d2a48a1f import updated python module from progguide branch 2020-08-26 09:01:59 -04:00
7ab6def2ca update list of Kokkos GPU archs in manual as well 2020-08-26 03:49:59 -04:00
abbbb0ab06 remove trailing whitespace 2020-08-26 03:42:50 -04:00
aa6dec84ed update list of Kokkos supported architectures 2020-08-26 03:42:42 -04:00
e0439ac94f Add compression_level parameter to dump atom gz 2020-08-26 00:14:32 -04:00
5cb8e73655 Add checksum and compression_level as dump atom/zstd options 2020-08-25 23:59:17 -04:00
0d8454ac25 First version of Zstd dump atom 2020-08-25 23:27:42 -04:00
b8f59fd37c Update from master 2020-08-25 20:29:03 -06:00
4d90c2b74b Update Kokkos library in LAMMPS to v3.2 2020-08-25 20:21:48 -06:00
1c10aa6a4d GIFs are only supported in HTML 2020-08-25 17:15:34 -04:00
c256f2331f JPG folder is no longer needed in HTML output 2020-08-25 16:59:39 -04:00
ae5c0bd8d1 Remove targets to JPG images 2020-08-25 16:44:50 -04:00
3a638440a4 Add missing PDF folder 2020-08-25 16:12:09 -04:00
80e07c69f0 add part of developer guide as to showcase the integration of the programmer guide 2020-08-25 15:07:09 -04:00
df8fb26272 Refactor changes to documentation build
- Added CMake variables for readability
- Moved Mathjax files to _static to avoid special copy logic
- Moved JPG/lammps-logo.png to _static to avoid special copy logic
- Removed dead CMake code
2020-08-25 13:41:31 -04:00
14b66d1f84 tweak test tolerance of reax/c tests for running on ubuntu 18.04 2020-08-25 12:15:19 -04:00
f965786e74 refactor C library interface and add doxygen decorations 2020-08-25 11:45:07 -04:00
69cffb2d04 import test infrastructure for c, c++ and python library usage 2020-08-25 11:03:31 -04:00
024e4c5f21 make formatting and doxygen decorations for utils functions consistent 2020-08-24 20:55:13 -04:00
3f685c346f add doxygen integration with conventional and cmake doc build 2020-08-24 17:58:37 -04:00
dc241abb85 Merge pull request #2305 from akohlmey/next_patch_version
Update version strings for updated patch release
patch_24Aug2020
2020-08-24 13:46:50 -04:00
8cbc3e421f clean up 2020-08-24 17:49:38 +02:00
93e4ed9770 Merge pull request #2304 from akohlmey/collected-small-changes
Collected small changes for the next patch release
2020-08-24 11:43:42 -04:00
090ef2d1e8 merge error fix 2020-08-24 17:10:33 +02:00
9bdb7b5b98 gatherscatter 2020-08-24 17:09:16 +02:00
28d59ce594 final steps 2020-08-24 17:04:35 +02:00
2ee6e9077a Merge remote-tracking branch 'upstream/master' into 2020 2020-08-24 17:02:53 +02:00
e8fb7c7ece big update 2020-08-24 16:54:16 +02:00
7e1a3bd4d5 Merge pull request #2302 from akohlmey/consistent-doc-headers
Consistent subsection headers for commands
2020-08-24 10:52:09 -04:00
47a44732e7 add test for fix restrain 2020-08-23 15:29:58 -04:00
8f5e8300ea fix typos in fix restrain docs 2020-08-23 15:29:49 -04:00